4-(5-bromanylthiophen-2-yl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]butanamide

Systemtic Name: 4-(5-bromanylthiophen-2-yl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]butanamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-4-(5-bromo-2-thienyl)butanamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-4-(5-bromo-2-thiophenyl)butanamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-4-(5-bromothiophen-2-yl)butanamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-4-(5-bromo-2-thienyl)butyramide Formula: C21H26BrN3O2S MolecularWeight: 464.41904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCCC2=CC=C(S2)Br)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)CCCC2=CC=C(S2)Br)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26BrN3O2S/c22-19-10-9-18(28-19)7-4-8-20(26)23-17-11-13-25(14-12-17)15-21(27)24-16-5-2-1-3-6-16/h1-3,5-6,9-10,17H,4,7-8,11-15H2,(H,23,26)(H,24,27)